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1,3-Benzenediol, o-(4-methylbenzoyl)-o'-(2-methoxybenzoyl)-
SpectraBase Compound ID 3eRkANB6eBs
InChI InChI=1S/C22H18O5/c1-15-10-12-16(13-11-15)21(23)26-17-6-5-7-18(14-17)27-22(24)19-8-3-4-9-20(19)25-2/h3-14H,1-2H3
InChIKey YKAUQBZMUPNUKE-UHFFFAOYSA-N
Mol Weight 362.38 g/mol
Molecular Formula C22H18O5
Exact Mass 362.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3sAFpfjY1YC
Name 1,3-Benzenediol, o-(4-methylbenzoyl)-o'-(2-methoxybenzoyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.115423675 u
Formula C22H18O5
InChI InChI=1S/C22H18O5/c1-15-10-12-16(13-11-15)21(23)26-17-6-5-7-18(14-17)27-22(24)19-8-3-4-9-20(19)25-2/h3-14H,1-2H3
InChIKey YKAUQBZMUPNUKE-UHFFFAOYSA-N
Molecular Weight 362.381 g/mol
SMILES C1=C(C=CC=C1OC(=O)C1=CC=C(C=C1)C)OC(=O)C=1C(OC)=CC=CC1